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5633-20-5

5633-20-5 structural image
Product Name: Oxybutynin
Formula: C22H31NO3
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Melting Point 122-124
Solubility 50 mg/mL
LogP 4.3
LogS -4.6
Dissociation Constants 8.04

COMPUTED DESCRIPTORS

Molecular Weight 357.5 g/mol
XLogP3 4.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 8
Exact Mass 357.23039385 g/mol
Monoisotopic Mass 357.23039385 g/mol
Topological Polar Surface Area 49.8 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 490
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Oxybutynin is a racemate comprising equimolar amounts of (R)-oxybutynin and esoxybutynin. An antispasmodic used for the treatment of overactive bladder. It has a role as a muscarinic antagonist, a muscle relaxant, an antispasmodic drug, a parasympatholytic, a calcium channel blocker and a local anaesthetic. It is a tertiary amino compound and a racemate. It contains an esoxybutynin and a (R)-oxybutynin.

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